![3-O-{BETA-XYLOPYRANOSYL(1->2)-[BETA-XYLOPYR.(1->3)]-BETA-GLUCOPYR.(1->4)-[ALPHA-RHAMNOPYR.(1->2)]-BETA-GALACTOPYR.}-26-O-BETA-GLUCOPYR.-22-METH.-FUROSTAN-DIOL](/api/spectrum/7pZ05S8iBlJ/structure.png?h=300&w=458 "3-O-{BETA-XYLOPYRANOSYL(1->2)-[BETA-XYLOPYR.(1->3)]-BETA-GLUCOPYR.(1->4)-[ALPHA-RHAMNOPYR.(1->2)]-BETA-GALACTOPYR.}-26-O-BETA-GLUCOPYR.-22-METH.-FUROSTAN-DIOL")
| SpectraBase Compound ID | 8gcfuUF8NHV |
|---|---|
| InChI | InChI=1S/C62H104O31/c1-23(20-81-54-47(77)44(74)41(71)34(17-63)86-54)9-14-62(80-6)24(2)37-33(93-62)16-30-28-8-7-26-15-27(10-12-60(26,4)29(28)11-13-61(30,37)5)85-58-52(91-57-48(78)43(73)38(68)25(3)84-57)49(79)50(36(19-65)88-58)89-59-53(92-56-46(76)40(70)32(67)22-83-56)51(42(72)35(18-64)87-59)90-55-45(75)39(69)31(66)21-82-55/h23-59,63-79H,7-22H2,1-6H3/t23-,24+,25-,26?,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38-,39-,40-,41+,42+,43+,44-,45+,46+,47+,48+,49-,50-,51-,52+,53+,54+,55-,56-,57+,58+,59+,60+,61+,62-/m1/s1 |
| InChIKey | YHVNCBGBSMUHPF-AICOQXKZSA-N |
| Mol Weight | 1345.5 g/mol |
| Molecular Formula | C62H104O31 |
| Exact Mass | 1344.656157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7pZ05S8iBlJ |
|---|---|
| Name | 3-O-{BETA-XYLOPYRANOSYL(1->2)-[BETA-XYLOPYR.(1->3)]-BETA-GLUCOPYR.(1->4)-[ALPHA-RHAMNOPYR.(1->2)]-BETA-GALACTOPYR.}-26-O-BETA-GLUCOPYR.-22-METH.-FUROSTAN-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H104O31 |
| InChI | InChI=1S/C62H104O31/c1-23(20-81-54-47(77)44(74)41(71)34(17-63)86-54)9-14-62(80-6)24(2)37-33(93-62)16-30-28-8-7-26-15-27(10-12-60(26,4)29(28)11-13-61(30,37)5)85-58-52(91-57-48(78)43(73)38(68)25(3)84-57)49(79)50(36(19-65)88-58)89-59-53(92-56-46(76)40(70)32(67)22-83-56)51(42(72)35(18-64)87-59)90-55-45(75)39(69)31(66)21-82-55/h23-59,63-79H,7-22H2,1-6H3/t23-,24+,25-,26?,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38-,39-,40-,41+,42+,43+,44-,45+,46+,47+,48+,49-,50-,51-,52+,53+,54+,55-,56-,57+,58+,59+,60+,61+,62-/m1/s1 |
| InChIKey | YHVNCBGBSMUHPF-AICOQXKZSA-N |
| Literature Reference Author | Y.X.XU,H.S.CHEN,H.Q.LIANG,Z.B.GU,W.Y.LIU,W.H.LEUNG,T.J.LI |
| Literature Reference Citation | PLANTA.MED.,66,545(2000) |
| Literature Reference DOI | 10.1055/s-2000-8609 |
| Molecular Weight | 1345.489 g/mol |
| Solvent | PYRIDINE |
| Source File Reference | UIAP1457 |